(2S)-2-methyl-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine

Systemtic Name: (2S)-2-methyl-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: (2S)-2-methyl-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine CAS Name: (2S)-2-methyl-6-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: (2S)-2-methyl-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: (2S)-2-methyl-6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC3=C(C=C2)OC(CN3)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=CC3=C(C=C2)O[C@H](CN3)C

InChI

InChI=1S/C16H24N2O/c1-12-5-3-4-8-18(12)11-14-6-7-16-15(9-14)17-10-13(2)19-16/h6-7,9,12-13,17H,3-5,8,10-11H2,1-2H3/p+1/t12-,13-/m0/s1